#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzj s SER 2 N 0.00 4.77 0.20 1.61 0.01 -1.26 -5.06 113.70 113.97 2dzj s SER 2 Ca 0.00 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.30 2dzj s SER 2 Cb 0.00 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2dzj s SER 2 CO 0.00 -1.56 0.00 -1.20 0.41 0.00 0.00 173.24 170.89 2dzj n SER 3 N -2.72 0.41 0.00 2.44 7.64 -1.26 -5.16 113.62 114.96 2dzj n SER 3 Ca 0.10 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.30 2dzj n SER 3 Cb 0.60 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 2dzj n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dzj n GLY 4 N 2.44 3.46 2.93 0.23 0.00 -1.26 -5.09 105.19 107.90 2dzj n GLY 4 Ca 0.00 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 2dzj n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dzj s SER 5 N 1.66 4.89 -0.17 1.61 1.04 -1.26 -5.02 113.70 116.44 2dzj s SER 5 Ca 0.00 -3.70 -0.04 0.00 0.48 0.00 0.00 55.95 52.69 2dzj s SER 5 Cb 0.00 -1.67 0.08 0.00 0.10 0.00 0.00 66.02 64.53 2dzj s SER 5 CO 0.00 -0.12 0.23 -0.44 0.98 0.00 0.00 173.24 173.89 2dzj s SER 6 N -1.11 1.02 -0.56 7.02 0.01 -1.26 -5.05 113.70 113.77 2dzj s SER 6 Ca 0.24 0.05 0.05 0.00 1.31 0.00 0.00 55.95 57.59 2dzj s SER 6 Cb -0.08 0.47 0.36 0.00 0.21 0.00 0.00 66.02 66.98 2dzj s SER 6 CO -0.13 -0.30 1.04 0.61 0.41 0.00 0.00 173.24 174.87 2dzj n GLY 7 N 5.33 5.74 3.24 3.44 0.00 -1.26 -5.01 105.19 116.67 2dzj n GLY 7 Ca -0.05 -2.77 -0.36 0.00 0.00 0.00 0.00 46.02 42.84 2dzj n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dzj s MET 8 N -3.53 2.82 -0.30 1.61 -2.45 -1.26 -5.06 119.30 111.13 2dzj s MET 8 Ca 0.48 -1.01 -0.08 0.00 -1.25 0.00 0.00 55.69 53.83 2dzj s MET 8 Cb 0.31 -3.16 0.15 0.00 1.25 0.00 0.00 34.83 33.38 2dzj s MET 8 CO -0.16 -0.47 0.69 -1.59 1.05 0.00 0.00 175.02 174.54 2dzj s LYS 9 N 1.37 0.53 0.56 4.11 -2.85 -1.26 -5.17 119.74 117.02 2dzj s LYS 9 Ca -0.00 1.19 0.06 0.00 -1.00 0.00 0.00 55.97 56.22 2dzj s LYS 9 Cb -0.18 0.70 0.06 0.00 -2.06 0.00 0.00 37.83 36.35 2dzj s LYS 9 CO -0.01 -0.32 0.48 0.72 0.10 0.00 0.00 175.35 176.31 2dzj n HIS 10 N 5.39 -0.84 -3.46 1.78 8.25 -1.26 -5.08 115.22 120.00 2dzj n HIS 10 Ca -0.08 -2.31 -0.37 0.00 -0.26 0.00 0.00 57.72 54.70 2dzj n HIS 10 Cb 0.50 -0.47 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 2dzj n HIS 10 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2dzj s TYR 11 N -2.73 3.68 -0.39 4.41 1.51 -0.84 -4.92 117.35 118.06 2dzj s TYR 11 Ca 0.36 1.00 -0.12 0.00 -1.01 0.00 0.00 57.07 57.30 2dzj s TYR 11 Cb -0.03 -2.30 0.03 0.00 -0.11 0.00 0.00 41.96 39.55 2dzj s TYR 11 CO 0.23 0.56 0.24 -1.21 -1.11 0.00 0.00 175.55 174.26 2dzj s GLU 12 N -1.48 2.85 -0.24 -0.62 2.02 -0.72 -3.24 118.70 117.28 2dzj s GLU 12 Ca 0.30 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.21 2dzj s GLU 12 Cb -0.16 -3.81 0.03 0.00 0.10 0.00 0.00 34.13 30.29 2dzj s GLU 12 CO 0.17 -0.73 -0.11 0.08 0.02 0.00 0.00 175.26 174.69 2dzj s VAL 13 N 1.59 2.48 -0.49 2.63 1.01 -0.51 -0.46 120.40 126.65 2dzj s VAL 13 Ca 0.03 -1.17 -0.10 0.00 0.00 0.00 0.00 61.98 60.73 2dzj s VAL 13 Cb -0.19 -2.27 0.12 0.00 0.00 0.00 0.00 36.38 34.04 2dzj s VAL 13 CO 0.08 0.22 0.37 -1.83 0.00 0.00 0.00 175.10 173.94 2dzj s GLU 14 N 1.25 2.56 -0.75 2.72 -1.05 -1.04 -1.57 118.70 120.82 2dzj s GLU 14 Ca -0.01 -1.79 -0.26 0.00 -0.15 0.00 0.00 54.97 52.76 2dzj s GLU 14 Cb -0.17 -3.97 0.01 0.00 -0.44 0.00 0.00 34.13 29.56 2dzj s GLU 14 CO -0.07 -1.21 1.53 0.42 0.95 0.00 0.00 175.26 176.88 2dzj s ILE 15 N 1.34 3.61 0.45 1.83 1.01 -0.80 -3.14 121.20 125.50 2dzj s ILE 15 Ca 0.06 0.14 0.08 0.00 0.00 0.00 0.00 60.65 60.93 2dzj s ILE 15 Cb -0.26 -4.57 0.02 0.00 0.01 0.00 0.00 42.46 37.66 2dzj s ILE 15 CO -0.01 -1.51 0.62 -0.76 0.00 0.00 0.00 174.94 173.29 2dzj s LEU 16 N 7.01 3.55 0.36 2.97 1.43 0.55 -2.66 118.68 131.88 2dzj s LEU 16 Ca 0.49 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 2dzj s LEU 16 Cb -0.08 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.56 2dzj s LEU 16 CO 0.13 -0.88 0.66 -0.62 0.23 0.00 0.00 176.35 175.87 2dzj s ASP 17 N -4.40 6.43 0.00 2.29 2.15 -1.25 0.63 116.67 122.52 2dzj s ASP 17 Ca 0.56 0.86 0.29 0.00 0.43 0.00 0.00 52.55 54.69 2dzj s ASP 17 Cb -0.09 -2.21 1.20 0.00 -0.30 0.00 0.00 42.92 41.52 2dzj s ASP 17 CO 0.34 -0.33 1.83 0.00 -0.17 0.00 0.00 175.17 176.84 2dzj n ALA 18 N -1.35 2.65 -0.29 3.66 0.00 -0.40 -2.87 120.51 121.92 2dzj n ALA 18 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2dzj n ALA 18 Cb 0.54 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2dzj n ALA 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2dzj n LYS 19 N -0.20 0.00 0.04 0.00 3.00 -1.26 -4.82 118.16 114.92 2dzj n LYS 19 Ca 0.19 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.64 2dzj n LYS 19 Cb 0.30 0.00 0.54 0.00 0.00 0.00 0.00 35.03 35.87 2dzj n LYS 19 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2dzj n THR 20 N -2.06 0.20 -2.59 3.15 -2.24 -1.26 -4.90 114.28 104.58 2dzj n THR 20 Ca 0.00 -0.10 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 2dzj n THR 20 Cb 0.00 -0.51 -0.00 0.00 -2.10 0.00 0.00 70.33 67.71 2dzj n THR 20 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dzj n ARG 21 N -1.76 -2.55 -2.90 -0.78 1.74 -1.14 -4.89 116.66 104.38 2dzj n ARG 21 Ca 0.06 0.43 -0.40 0.00 -0.77 0.00 0.00 57.85 57.17 2dzj n ARG 21 Cb 0.37 -5.02 -0.04 0.00 -1.02 0.00 0.00 32.46 26.75 2dzj n ARG 21 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2dzj s GLU 22 N -5.17 4.53 -0.20 5.56 2.56 -1.26 -4.47 118.70 120.25 2dzj s GLU 22 Ca 0.06 1.16 -0.37 0.00 0.00 0.00 0.00 54.97 55.82 2dzj s GLU 22 Cb -0.03 -3.40 -0.13 0.00 2.00 0.00 0.00 34.13 32.56 2dzj s GLU 22 CO 0.07 0.15 1.86 1.17 -0.56 0.00 0.00 175.26 177.96 2dzj n LYS 23 N 3.25 1.62 -0.11 4.30 3.00 -1.26 -3.74 118.16 125.21 2dzj n LYS 23 Ca 0.00 0.58 -0.15 0.00 -0.00 0.00 0.00 58.31 58.74 2dzj n LYS 23 Cb 0.50 -2.40 -0.10 0.00 0.00 0.00 0.00 35.03 33.04 2dzj n LYS 23 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2dzj n LEU 24 N 6.51 2.92 -3.58 3.14 4.77 -1.09 -5.04 117.00 124.63 2dzj n LEU 24 Ca 0.26 -0.10 -0.16 0.00 -0.03 0.00 0.00 56.01 55.98 2dzj n LEU 24 Cb 0.22 -0.76 -0.07 0.00 -2.33 0.00 0.00 43.42 40.48 2dzj n LEU 24 CO 0.77 0.85 0.38 0.00 -1.33 0.00 0.00 177.39 178.06 2dzj s PHE 26 N -0.70 1.91 -0.54 0.00 5.36 -1.26 -1.90 117.98 120.85 2dzj s PHE 26 Ca -0.08 -1.74 -0.15 0.00 -0.96 0.00 0.00 56.93 54.01 2dzj s PHE 26 Cb -0.02 -1.72 0.13 0.00 -0.34 0.00 0.00 43.02 41.07 2dzj s PHE 26 CO 0.07 -0.83 0.48 -0.51 -1.46 0.00 0.00 175.22 172.97 2dzj s LEU 27 N 1.55 6.12 0.00 6.12 1.43 -0.61 -4.88 118.68 128.41 2dzj s LEU 27 Ca 0.06 -1.85 0.19 0.00 -1.03 0.00 0.00 54.13 51.50 2dzj s LEU 27 Cb -0.18 -2.17 0.52 0.00 0.03 0.00 0.00 46.19 44.39 2dzj s LEU 27 CO -0.18 -0.82 1.43 -0.67 0.23 0.00 0.00 176.35 176.34 2dzj n ASP 28 N 5.14 2.93 -1.74 2.29 -0.08 -1.25 -1.43 116.55 122.40 2dzj n ASP 28 Ca -0.12 -1.97 -0.13 0.00 -1.51 0.00 0.00 54.79 51.06 2dzj n ASP 28 Cb 0.40 -0.32 0.07 0.00 2.34 0.00 0.00 41.12 43.61 2dzj n ASP 28 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2dzj n LYS 29 N 1.11 2.80 -3.43 -0.67 5.02 -1.23 -3.99 118.16 117.77 2dzj n LYS 29 Ca 0.19 -3.81 -0.34 0.00 -2.02 0.00 0.00 58.31 52.32 2dzj n LYS 29 Cb 0.48 -1.96 -0.06 0.00 -0.02 0.00 0.00 35.03 33.47 2dzj n LYS 29 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2dzj s VAL 30 N -4.01 4.94 0.28 -0.18 1.01 -1.20 -4.88 120.40 116.36 2dzj s VAL 30 Ca 0.45 0.63 -0.20 0.00 0.00 0.00 0.00 61.98 62.86 2dzj s VAL 30 Cb 0.39 -3.68 -0.09 0.00 0.00 0.00 0.00 36.38 33.00 2dzj s VAL 30 CO -0.00 0.17 0.78 -1.61 0.00 0.00 0.00 175.10 174.44 2dzj s GLU 31 N -2.18 4.24 0.29 2.72 2.02 -1.26 -1.99 118.70 122.54 2dzj s GLU 31 Ca 0.39 0.91 0.08 0.00 0.02 0.00 0.00 54.97 56.37 2dzj s GLU 31 Cb -0.14 -2.70 0.44 0.00 0.10 0.00 0.00 34.13 31.84 2dzj s GLU 31 CO 0.20 0.28 1.68 -1.00 0.02 0.00 0.00 175.26 176.44 2dzj h PRO 32 N 2.96 0.16 0.00 0.39 0.13 -1.98 -2.77 132.00 130.89 2dzj h PRO 32 Ca -0.48 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2dzj h PRO 32 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dzj h PRO 32 CO 0.65 0.60 -0.21 -2.39 -0.23 0.00 0.00 178.00 176.42 2dzj n HIS 33 N -3.97 0.54 -1.73 1.56 1.44 -1.26 -2.16 115.22 109.63 2dzj n HIS 33 Ca -0.02 0.16 -0.42 0.00 -2.01 0.00 0.00 57.72 55.43 2dzj n HIS 33 Cb 0.51 -0.70 -0.03 0.00 0.12 0.00 0.00 29.99 29.90 2dzj n HIS 33 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2dzj s ALA 34 N -3.08 3.91 0.44 1.59 0.00 -1.05 -4.81 121.76 118.75 2dzj s ALA 34 Ca 0.10 1.60 -0.03 0.00 0.00 0.00 0.00 51.96 53.63 2dzj s ALA 34 Cb 0.15 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2dzj s ALA 34 CO 0.63 -0.95 0.71 0.95 0.00 0.00 0.00 175.76 177.10 2dzj s THR 35 N 0.93 4.96 0.29 0.00 -4.23 -1.26 -2.87 115.64 113.47 2dzj s THR 35 Ca 0.73 -0.02 0.04 0.00 -1.18 0.00 0.00 61.69 61.26 2dzj s THR 35 Cb -0.50 -3.86 0.29 0.00 1.34 0.00 0.00 72.50 69.77 2dzj s THR 35 CO 0.35 -0.75 1.71 0.40 -0.54 0.00 0.00 174.62 175.79 2dzj h ILE 36 N 0.39 0.50 -0.68 2.99 1.08 -1.50 0.47 117.51 120.77 2dzj h ILE 36 Ca -0.48 -0.15 0.14 0.00 -0.39 0.00 0.00 64.86 63.98 2dzj h ILE 36 Cb 1.21 0.02 -0.10 0.00 -3.07 0.00 0.00 36.82 34.88 2dzj h ILE 36 CO 0.61 0.08 0.12 0.00 -0.69 0.00 0.00 178.15 178.28 2dzj h ALA 37 N 1.70 0.81 -0.27 1.87 0.00 -1.86 -1.24 119.26 120.27 2dzj h ALA 37 Ca 0.57 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.62 2dzj h ALA 37 Cb 1.07 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2dzj h ALA 37 CO -0.51 -0.34 0.07 0.93 0.00 0.00 0.00 179.25 179.40 2dzj h GLU 38 N 0.23 0.43 -0.89 0.00 4.39 -1.29 -3.03 114.58 114.43 2dzj h GLU 38 Ca 0.37 -0.10 0.23 0.00 0.34 0.00 0.00 59.36 60.19 2dzj h GLU 38 Cb 0.60 -0.06 -0.16 0.00 -0.10 0.00 0.00 28.75 29.04 2dzj h GLU 38 CO -0.49 0.52 0.04 0.82 -1.16 0.00 0.00 179.01 178.74 2dzj h ILE 39 N 0.26 0.18 -0.12 3.13 1.08 -0.82 0.13 117.51 121.36 2dzj h ILE 39 Ca 0.08 -0.03 0.04 0.00 -0.39 0.00 0.00 64.86 64.57 2dzj h ILE 39 Cb 0.28 0.10 -0.05 0.00 -3.07 0.00 0.00 36.82 34.08 2dzj h ILE 39 CO 0.00 0.01 -0.19 0.11 -0.69 0.00 0.00 178.15 177.40 2dzj h LYS 40 N 0.08 -0.23 -0.45 2.37 6.56 -1.36 -2.49 116.57 121.05 2dzj h LYS 40 Ca 0.52 0.02 0.09 0.00 -1.06 0.00 0.00 60.65 60.21 2dzj h LYS 40 Cb 1.00 0.05 -0.10 0.00 -0.57 0.00 0.00 32.23 32.62 2dzj h LYS 40 CO -0.79 -0.16 -0.25 -0.91 -2.06 0.00 0.00 179.45 175.28 2dzj h ASN 41 N -0.24 -0.87 -0.59 0.86 2.35 -0.80 -0.92 115.58 115.38 2dzj h ASN 41 Ca 0.09 0.18 0.08 0.00 -0.55 0.00 0.00 56.30 56.10 2dzj h ASN 41 Cb 0.38 0.44 -0.10 0.00 0.05 0.00 0.00 38.32 39.09 2dzj h ASN 41 CO -0.26 -0.27 -0.48 -0.07 -1.65 0.00 0.00 177.43 174.70 2dzj h LEU 42 N -0.16 -1.67 -0.35 1.61 3.38 -1.02 -0.08 115.31 117.02 2dzj h LEU 42 Ca 0.21 0.26 0.05 0.00 0.09 0.00 0.00 57.88 58.48 2dzj h LEU 42 Cb 0.49 0.74 -0.05 0.00 0.09 0.00 0.00 40.66 41.93 2dzj h LEU 42 CO -0.54 -0.34 0.07 0.15 0.09 0.00 0.00 178.44 177.87 2dzj h PHE 43 N -0.24 0.12 -0.93 1.13 3.04 -1.16 -1.90 116.94 116.99 2dzj h PHE 43 Ca 0.15 0.02 0.20 0.00 3.98 0.00 0.00 57.97 62.33 2dzj h PHE 43 Cb 0.56 -0.00 -0.11 0.00 2.56 0.00 0.00 35.95 38.95 2dzj h PHE 43 CO -0.75 0.03 0.49 1.15 -2.02 0.00 0.00 178.31 177.20 2dzj h THR 44 N 0.20 0.59 -0.25 4.41 2.02 0.27 -2.66 112.91 117.49 2dzj h THR 44 Ca 0.17 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.18 2dzj h THR 44 Cb 0.18 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.54 2dzj h THR 44 CO -0.21 0.10 -0.15 0.29 0.37 0.00 0.00 175.52 175.92 2dzj n LYS 45 N -4.92 -0.11 0.28 6.66 5.02 -0.35 -1.41 118.16 123.32 2dzj n LYS 45 Ca 0.22 0.96 -0.16 0.00 -2.02 0.00 0.00 58.31 57.30 2dzj n LYS 45 Cb 0.61 -1.42 -0.08 0.00 -0.02 0.00 0.00 35.03 34.11 2dzj n LYS 45 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2dzj h THR 46 N 0.00 0.34 -3.34 -0.18 2.02 -1.61 -3.36 112.91 106.78 2dzj h THR 46 Ca 0.04 0.00 -0.73 0.00 0.77 0.00 0.00 66.41 66.49 2dzj h THR 46 Cb 0.10 0.34 -0.29 0.00 -1.74 0.00 0.00 68.15 66.56 2dzj h THR 46 CO -0.24 0.00 -0.35 -1.00 0.37 0.00 0.00 175.52 174.30 2dzj s HIS 47 N -6.04 3.44 0.11 3.16 3.76 -0.50 -4.94 115.29 114.28 2dzj s HIS 47 Ca -0.17 -1.92 -0.14 0.00 -0.15 0.00 0.00 55.06 52.68 2dzj s HIS 47 Cb 0.05 -3.51 -0.07 0.00 1.11 0.00 0.00 32.58 30.16 2dzj s HIS 47 CO 0.63 -0.99 1.44 -1.00 -0.85 0.00 0.00 174.74 173.97 2dzj h PRO 48 N 8.32 0.78 -0.94 8.40 0.13 -1.53 -3.09 132.00 144.07 2dzj h PRO 48 Ca -0.18 -0.41 0.24 0.00 -0.87 0.00 0.00 66.00 64.78 2dzj h PRO 48 Cb 1.06 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.15 2dzj h PRO 48 CO 0.85 1.04 0.64 1.96 -0.23 0.00 0.00 178.00 182.26 2dzj h GLN 49 N 0.55 0.25 -6.03 0.86 1.08 -1.92 -3.33 115.11 106.57 2dzj h GLN 49 Ca 0.05 -0.01 -0.59 0.00 -1.45 0.00 0.00 58.65 56.65 2dzj h GLN 49 Cb 0.89 -0.06 -0.10 0.00 -0.05 0.00 0.00 27.48 28.16 2dzj h GLN 49 CO 0.08 0.16 1.15 -1.58 -0.95 0.00 0.00 178.83 177.69 2dzj s TRP 50 N -5.27 2.50 0.71 2.96 0.52 -1.17 -5.01 118.94 114.18 2dzj s TRP 50 Ca -0.07 -0.54 -0.11 0.00 0.02 0.00 0.00 56.10 55.40 2dzj s TRP 50 Cb 0.23 -4.58 0.02 0.00 -1.15 0.00 0.00 33.47 27.98 2dzj s TRP 50 CO 0.78 -1.92 1.07 1.52 0.02 0.00 0.00 176.95 178.42 2dzj s TYR 51 N 4.97 3.04 -0.47 -1.98 1.13 -1.25 -4.60 117.35 118.18 2dzj s TYR 51 Ca 0.37 1.42 0.24 0.00 -1.41 0.00 0.00 57.07 57.69 2dzj s TYR 51 Cb -0.06 -2.91 0.99 0.00 -1.10 0.00 0.00 41.96 38.88 2dzj s TYR 51 CO 0.03 -1.33 1.71 -0.35 -2.51 0.00 0.00 175.55 173.10 2dzj n PRO 52 N -3.19 0.19 0.23 -3.49 -0.04 -1.26 -2.13 135.00 125.31 2dzj n PRO 52 Ca 0.08 0.43 0.12 0.00 -0.04 0.00 0.00 63.50 64.09 2dzj n PRO 52 Cb 0.54 -1.88 0.31 0.00 -0.04 0.00 0.00 33.50 32.43 2dzj n PRO 52 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dzj h ALA 53 N 2.26 0.97 0.00 0.55 0.00 -2.01 -3.32 119.26 117.71 2dzj h ALA 53 Ca 0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 54.91 54.50 2dzj h ALA 53 Cb 0.36 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 2dzj h ALA 53 CO 0.00 0.08 -2.33 -2.13 0.00 0.00 0.00 179.25 174.87 2dzj n ARG 54 N -3.13 0.57 -1.88 0.00 0.63 -0.98 -4.86 116.66 107.01 2dzj n ARG 54 Ca 0.03 0.14 -0.37 0.00 -0.92 0.00 0.00 57.85 56.73 2dzj n ARG 54 Cb 0.49 -1.46 -0.03 0.00 0.45 0.00 0.00 32.46 31.91 2dzj n ARG 54 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2dzj s GLN 55 N -2.46 2.45 0.07 -0.14 -0.21 -0.91 -4.46 119.66 114.00 2dzj s GLN 55 Ca -0.32 0.85 -0.05 0.00 0.02 0.00 0.00 55.36 55.86 2dzj s GLN 55 Cb 0.09 -4.46 -0.05 0.00 1.00 0.00 0.00 33.01 29.58 2dzj s GLN 55 CO 0.52 -2.93 0.32 0.45 -2.12 0.00 0.00 175.29 171.53 2dzj s SER 56 N 9.43 6.49 -0.01 5.90 0.15 -1.26 -4.88 113.70 129.53 2dzj s SER 56 Ca 0.77 0.56 0.05 0.00 0.70 0.00 0.00 55.95 58.03 2dzj s SER 56 Cb -0.14 -2.08 -0.01 0.00 -1.71 0.00 0.00 66.02 62.08 2dzj s SER 56 CO 0.22 0.16 -0.16 -0.76 1.20 0.00 0.00 173.24 173.90 2dzj s LEU 57 N -2.22 2.04 -0.07 3.45 1.43 -1.25 -3.17 118.68 118.90 2dzj s LEU 57 Ca 0.34 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 53.09 2dzj s LEU 57 Cb -0.13 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.31 2dzj s LEU 57 CO 0.21 0.19 0.18 -0.13 0.23 0.00 0.00 176.35 177.03 2dzj s ARG 58 N -0.43 0.20 0.59 1.70 0.52 -0.81 -1.51 118.95 119.22 2dzj s ARG 58 Ca 0.06 0.28 0.31 0.00 -0.52 0.00 0.00 55.73 55.86 2dzj s ARG 58 Cb -0.06 0.06 1.84 0.00 0.52 0.00 0.00 34.95 37.31 2dzj s ARG 58 CO -0.00 -0.05 2.24 -0.07 0.02 0.00 0.00 175.30 177.44 2dzj h LEU 59 N 6.07 0.00 -7.61 2.53 3.38 -1.82 -1.26 115.31 116.60 2dzj h LEU 59 Ca -0.28 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.57 2dzj h LEU 59 Cb 1.19 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.74 2dzj h LEU 59 CO 0.40 0.02 -0.35 -1.81 0.09 0.00 0.00 178.44 176.78 2dzj s ASP 60 N -6.04 -0.09 0.08 -0.43 1.01 -1.26 -4.83 116.67 105.11 2dzj s ASP 60 Ca -0.05 -0.08 0.17 0.00 0.71 0.00 0.00 52.55 53.30 2dzj s ASP 60 Cb 0.15 0.28 0.72 0.00 1.01 0.00 0.00 42.92 45.08 2dzj s ASP 60 CO 0.54 -0.45 1.53 -0.81 0.21 0.00 0.00 175.17 176.19 2dzj n PRO 61 N 1.20 0.06 -0.30 8.23 -0.04 -1.26 -2.44 135.00 140.45 2dzj n PRO 61 Ca -0.21 0.31 0.07 0.00 -0.04 0.00 0.00 63.50 63.62 2dzj n PRO 61 Cb 0.56 -1.62 0.11 0.00 -0.04 0.00 0.00 33.50 32.51 2dzj n PRO 61 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2dzj n LYS 62 N -1.73 0.92 0.00 0.54 -0.00 -1.26 -5.04 118.16 111.60 2dzj n LYS 62 Ca 0.03 -2.22 0.00 0.00 -0.00 0.00 0.00 58.31 56.12 2dzj n LYS 62 Cb 0.18 -1.19 0.00 0.00 -0.00 0.00 0.00 35.03 34.03 2dzj n LYS 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dzj n GLY 63 N -0.95 2.60 3.79 2.58 0.00 -1.02 -5.16 105.19 107.04 2dzj n GLY 63 Ca 0.12 -1.39 -0.32 0.00 0.00 0.00 0.00 46.02 44.43 2dzj n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dzj s LYS 64 N 4.82 2.22 0.13 1.61 -0.14 -1.26 -5.00 119.74 122.11 2dzj s LYS 64 Ca 0.00 -2.36 -0.24 0.00 -1.36 0.00 0.00 55.97 52.01 2dzj s LYS 64 Cb 0.00 -1.61 -0.07 0.00 -1.68 0.00 0.00 37.83 34.46 2dzj s LYS 64 CO 0.00 -0.42 0.74 -1.54 -0.76 0.00 0.00 175.35 173.36 2dzj s SER 65 N -3.95 7.31 0.68 2.83 1.04 -1.26 -4.30 113.70 116.04 2dzj s SER 65 Ca 0.08 1.55 -0.11 0.00 0.48 0.00 0.00 55.95 57.95 2dzj s SER 65 Cb 0.01 -2.47 -0.00 0.00 0.10 0.00 0.00 66.02 63.65 2dzj s SER 65 CO 0.05 0.20 1.07 -0.76 0.98 0.00 0.00 173.24 174.78 2dzj s LEU 66 N -1.01 3.02 0.10 2.42 1.43 -0.57 -5.01 118.68 119.05 2dzj s LEU 66 Ca 0.35 1.27 0.05 0.00 -1.03 0.00 0.00 54.13 54.76 2dzj s LEU 66 Cb -0.22 -4.16 -0.03 0.00 0.03 0.00 0.00 46.19 41.80 2dzj s LEU 66 CO 0.25 -1.19 -0.13 -0.54 0.23 0.00 0.00 176.35 174.97 2dzj s LYS 67 N -5.27 0.88 0.27 1.70 -0.14 -1.26 -4.89 119.74 111.03 2dzj s LYS 67 Ca 0.57 -1.11 -0.03 0.00 -1.36 0.00 0.00 55.97 54.05 2dzj s LYS 67 Cb -0.11 -0.74 0.58 0.00 -1.68 0.00 0.00 37.83 35.88 2dzj s LYS 67 CO 0.53 0.14 1.62 -0.44 -0.76 0.00 0.00 175.35 176.44 2dzj h ASP 68 N 3.81 -0.29 -1.22 2.83 3.32 -1.96 0.35 116.42 123.26 2dzj h ASP 68 Ca -0.39 0.22 0.43 0.00 0.02 0.00 0.00 57.03 57.31 2dzj h ASP 68 Cb 1.19 0.36 -0.15 0.00 0.22 0.00 0.00 39.33 40.95 2dzj h ASP 68 CO 0.48 -0.21 0.74 1.05 -1.72 0.00 0.00 179.24 179.58 2dzj h GLU 69 N 0.11 0.06 -7.02 3.56 4.11 -1.98 -3.26 114.58 110.15 2dzj h GLU 69 Ca 0.49 -0.00 -0.54 0.00 0.07 0.00 0.00 59.36 59.38 2dzj h GLU 69 Cb 0.93 -0.01 0.11 0.00 0.50 0.00 0.00 28.75 30.28 2dzj h GLU 69 CO -0.72 0.04 0.58 -0.51 0.07 0.00 0.00 179.01 178.47 2dzj s ASP 70 N -4.48 5.63 0.08 3.06 1.11 0.12 -4.93 116.67 117.27 2dzj s ASP 70 Ca -0.08 2.64 0.05 0.00 0.18 0.00 0.00 52.55 55.33 2dzj s ASP 70 Cb 0.31 -2.63 -0.03 0.00 1.07 0.00 0.00 42.92 41.65 2dzj s ASP 70 CO 0.81 -1.31 -0.12 -0.69 1.18 0.00 0.00 175.17 175.03 2dzj s VAL 71 N -1.36 1.03 -0.98 -1.27 1.01 -1.26 -2.34 120.40 115.22 2dzj s VAL 71 Ca 0.68 -1.42 0.03 0.00 0.00 0.00 0.00 61.98 61.26 2dzj s VAL 71 Cb -0.37 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 34.88 2dzj s VAL 71 CO 0.45 -0.35 1.08 0.18 0.00 0.00 0.00 175.10 176.46 2dzj n LEU 72 N 1.02 0.01 -0.00 3.92 4.77 -1.14 -0.06 117.00 125.52 2dzj n LEU 72 Ca -0.19 0.51 0.04 0.00 -0.03 0.00 0.00 56.01 56.34 2dzj n LEU 72 Cb 0.55 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 2dzj n LEU 72 CO 0.23 -0.47 -0.58 0.00 -1.33 0.00 0.00 177.39 175.24 2dzj n GLN 73 N -1.52 0.42 -0.03 3.23 10.64 -0.92 -4.59 117.38 124.61 2dzj n GLN 73 Ca 0.01 -0.08 -0.09 0.00 -1.83 0.00 0.00 57.00 55.01 2dzj n GLN 73 Cb 0.03 -1.20 -0.14 0.00 -0.86 0.00 0.00 30.24 28.07 2dzj n GLN 73 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2dzj n LYS 74 N -1.78 0.64 -1.17 2.61 4.76 -0.29 -4.95 118.16 117.98 2dzj n LYS 74 Ca -0.01 0.25 -0.34 0.00 -2.87 0.00 0.00 58.31 55.33 2dzj n LYS 74 Cb 0.23 -1.75 0.12 0.00 -1.84 0.00 0.00 35.03 31.79 2dzj n LYS 74 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2dzj n LEU 75 N -3.01 4.33 -0.75 -0.35 -0.00 0.91 -4.81 117.00 113.31 2dzj n LEU 75 Ca -0.20 0.61 0.00 0.00 -0.00 0.00 0.00 56.01 56.42 2dzj n LEU 75 Cb 1.07 -1.49 0.00 0.00 -0.00 0.00 0.00 43.42 43.00 2dzj n LEU 75 CO 0.45 -1.73 0.18 -0.81 -0.00 0.00 0.00 177.39 175.48 2dzj n PRO 76 N -2.97 0.49 -4.61 1.47 -0.04 -1.26 -4.73 135.00 123.34 2dzj n PRO 76 Ca 0.14 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.32 2dzj n PRO 76 Cb 0.50 -1.25 -0.11 0.00 -0.04 0.00 0.00 33.50 32.60 2dzj n PRO 76 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2dzj s VAL 77 N -0.23 2.00 0.00 0.52 1.01 -1.26 -5.16 120.40 117.27 2dzj s VAL 77 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2dzj s VAL 77 Cb 0.00 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2dzj s VAL 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 2dzj n GLY 78 N -0.98 4.27 0.26 4.51 0.00 -1.26 -4.88 105.19 107.10 2dzj n GLY 78 Ca -0.05 -2.12 0.07 0.00 0.00 0.00 0.00 46.02 43.93 2dzj n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dzj n THR 79 N -0.22 -0.30 -2.91 2.61 -2.24 -1.26 -3.01 114.28 106.94 2dzj n THR 79 Ca 0.00 1.62 -0.44 0.00 -2.27 0.00 0.00 64.05 62.97 2dzj n THR 79 Cb 0.00 -2.31 -0.03 0.00 -2.10 0.00 0.00 70.33 65.89 2dzj n THR 79 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2dzj s THR 80 N -5.77 4.56 0.06 4.28 2.01 -1.26 -1.76 115.64 117.75 2dzj s THR 80 Ca -0.10 -0.98 -0.03 0.00 0.31 0.00 0.00 61.69 60.89 2dzj s THR 80 Cb 0.20 -4.71 -0.05 0.00 0.01 0.00 0.00 72.50 67.96 2dzj s THR 80 CO 0.56 -1.45 0.26 0.00 -0.69 0.00 0.00 174.62 173.31 2dzj s ALA 81 N 3.30 3.91 -0.10 7.40 0.00 0.39 -4.99 121.76 131.67 2dzj s ALA 81 Ca 0.26 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.54 2dzj s ALA 81 Cb -0.12 -1.97 0.01 0.00 0.00 0.00 0.00 23.12 21.04 2dzj s ALA 81 CO 0.01 0.73 -0.14 0.99 0.00 0.00 0.00 175.76 177.35 2dzj s THR 82 N -1.47 1.40 -0.04 0.00 2.01 -1.26 -2.49 115.64 113.78 2dzj s THR 82 Ca 0.34 -0.60 0.07 0.00 0.31 0.00 0.00 61.69 61.81 2dzj s THR 82 Cb -0.13 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 2dzj s THR 82 CO 0.23 0.42 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.58 2dzj s LEU 83 N 0.93 2.05 -0.09 4.42 1.43 -1.19 -4.62 118.68 121.60 2dzj s LEU 83 Ca -0.08 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 2dzj s LEU 83 Cb -0.15 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 2dzj s LEU 83 CO -0.00 0.27 0.08 -0.31 0.23 0.00 0.00 176.35 176.62 2dzj s TYR 84 N -0.34 3.40 0.02 0.29 2.02 -0.48 -0.33 117.35 121.93 2dzj s TYR 84 Ca 0.02 0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 57.03 2dzj s TYR 84 Cb -0.12 -1.86 -0.05 0.00 -0.40 0.00 0.00 41.96 39.53 2dzj s TYR 84 CO 0.02 0.62 0.27 0.12 -1.57 0.00 0.00 175.55 175.00 2dzj s PHE 85 N -0.99 3.57 -0.03 2.71 2.19 0.21 -1.92 117.98 123.71 2dzj s PHE 85 Ca 0.15 0.55 0.03 0.00 0.33 0.00 0.00 56.93 57.99 2dzj s PHE 85 Cb -0.12 -1.97 0.00 0.00 -1.31 0.00 0.00 43.02 39.62 2dzj s PHE 85 CO 0.04 0.60 -0.12 0.50 1.83 0.00 0.00 175.22 178.08 2dzj s ARG 86 N -1.86 1.24 -0.28 10.12 6.06 -1.19 -1.28 118.95 131.76 2dzj s ARG 86 Ca 0.29 -0.40 -0.27 0.00 -2.50 0.00 0.00 55.73 52.85 2dzj s ARG 86 Cb -0.13 -1.12 0.01 0.00 0.06 0.00 0.00 34.95 33.77 2dzj s ARG 86 CO 0.17 0.15 0.94 0.16 -2.50 0.00 0.00 175.30 174.22 2dzj s ASP 87 N 0.16 6.87 0.00 -2.12 -4.77 -1.26 -4.05 116.67 111.51 2dzj s ASP 87 Ca -0.04 1.01 0.29 0.00 -3.30 0.00 0.00 52.55 50.52 2dzj s ASP 87 Cb -0.10 -2.48 1.33 0.00 -1.09 0.00 0.00 42.92 40.58 2dzj s ASP 87 CO 0.01 -0.69 1.90 0.18 0.70 0.00 0.00 175.17 177.28